(2-hydrazinyl-4-pyridinyl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone

C15H23N5O — CID 63174678

IUPAC(2-hydrazinyl-4-pyridinyl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone
SMILESNNc1cc(C(=O)N2CCC(N3CCCCC3)C2)ccn1
InChIInChI=1S/C15H23N5O/c16-18-14-10-12(4-6-17-14)15(21)20-9-5-13(11-20)19-7-2-1-3-8-19/h4,6,10,13H,1-3,5,7-9,11,16H2,(H,17,18)
InChIKeyAPYKWSOMNPLAKT-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.07
Rot. Bonds3

About (2-hydrazinyl-4-pyridinyl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone

(2-hydrazinyl-4-pyridinyl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone (PubChem CID 63174678) has the molecular formula C15H23N5O and a molecular weight of 289.38 g/mol. Its IUPAC name is (2-hydrazinyl-4-pyridinyl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone.

Molecular Properties

Compound Name(2-hydrazinyl-4-pyridinyl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone
PubChem CID63174678
Molecular FormulaC15H23N5O
Molecular Weight289.38 g/mol
Exact Mass289.19
IUPAC Name(2-hydrazinyl-4-pyridinyl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone
SMILESNNc1cc(C(=O)N2CCC(N3CCCCC3)C2)ccn1
InChIInChI=1S/C15H23N5O/c16-18-14-10-12(4-6-17-14)15(21)20-9-5-13(11-20)19-7-2-1-3-8-19/h4,6,10,13H,1-3,5,7-9,11,16H2,(H,17,18)
InChIKeyAPYKWSOMNPLAKT-UHFFFAOYSA-N
XLogP1.07
TPSA74.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl-(2-hydrazinyl-4-pyridinyl)methanone
CID 63155013
(6-amino-3-pyridinyl)-[(3R)-3-piperidin-1-ylpyrrolidin-1-yl]methanone
CID 95026394
(2-hydrazinyl-4-pyridinyl)-(2-methylpiperidin-1-yl)methanone
CID 62235741
(4-amino-3-hydroxyphenyl)-(3-pyrrolidin-1-ylpyrrolidin-1-yl)methanone
CID 107075245
1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl-(2-bromo-4-pyridinyl)methanone
CID 113255655
(4-iodophenyl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone
CID 63524427
(4-hydroxy-3-methylphenyl)-(3-pyrrolidin-1-ylpyrrolidin-1-yl)methanone
CID 103951868
(3-methylphenyl)-(3-pyrrolidin-1-ylpyrrolidin-1-yl)methanone
CID 110441496
(3,4-dimethoxypyrrolidin-1-yl)-(2-hydrazinyl-4-pyridinyl)methanone
CID 103538720
(4,4-dimethylazepan-1-yl)-(2-hydrazinyl-4-pyridinyl)methanone
CID 65286887
[3-(aminomethyl)phenyl]-(3-pyrrolidin-1-ylpyrrolidin-1-yl)methanone
CID 63168351
(2-hydrazinyl-4-pyridinyl)-(1,4-oxazepan-4-yl)methanone
CID 62969077

Frequently Asked Questions

What is the IUPAC name of (2-hydrazinyl-4-pyridinyl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone?
The IUPAC name of (2-hydrazinyl-4-pyridinyl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone (CID 63174678) is (2-hydrazinyl-4-pyridinyl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone.
What is the SMILES notation for (2-hydrazinyl-4-pyridinyl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone?
The canonical SMILES for (2-hydrazinyl-4-pyridinyl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone is NNc1cc(C(=O)N2CCC(N3CCCCC3)C2)ccn1.
What is the InChIKey of (2-hydrazinyl-4-pyridinyl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone?
The InChIKey is APYKWSOMNPLAKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O/c16-18-14-10-12(4-6-17-14)15(21)20-9-5-13(11-20)19-7-2-1-3-8-19/h4,6,10,13H,1-3,5,7-9,11,16H2,(H,17,18).
What are the key properties of (2-hydrazinyl-4-pyridinyl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone?
(2-hydrazinyl-4-pyridinyl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone has a molecular weight of 289.38 g/mol, XLogP of 1.07, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-hydrazinyl-4-pyridinyl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone is sourced from PubChem (CID 63174678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).